dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane

C15H9F9OSi — CID 91724032

IUPACdimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane
SMILESC[Si](C)(OCc1cc(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C15H9F9OSi/c1-26(2,15-13(23)11(21)10(20)12(22)14(15)24)25-4-5-3-6(16)8(18)9(19)7(5)17/h3H,4H2,1-2H3
InChIKeyRGASSVKESWAWPF-UHFFFAOYSA-N
MW404.30 g/mol
LogP4.57
Rot. Bonds4

About dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane

dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane (PubChem CID 91724032) has the molecular formula C15H9F9OSi and a molecular weight of 404.30 g/mol. Its IUPAC name is dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane.

Molecular Properties

Compound Namedimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane
PubChem CID91724032
Molecular FormulaC15H9F9OSi
Molecular Weight404.30 g/mol
Exact Mass404.03
IUPAC Namedimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane
SMILESC[Si](C)(OCc1cc(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C15H9F9OSi/c1-26(2,15-13(23)11(21)10(20)12(22)14(15)24)25-4-5-3-6(16)8(18)9(19)7(5)17/h3H,4H2,1-2H3
InChIKeyRGASSVKESWAWPF-UHFFFAOYSA-N
XLogP4.57
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.30
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

Benzyloxytrimethylsilane
CID 518982
2-(Dimethylphenylsilyl)benzyl alcohol
CID 11989421
(2-((4-Fluorophenyl)dimethylsilyl)phenyl)methanol
CID 11989534
2,2-Difluoro-1-phenyl-1-trimethylsiloxyethene
CID 10889667
Silane, triethyl(phenylmethoxy)-
CID 563229
((1-(2-Fluorophenyl)vinyl)oxy)trimethylsilane
CID 10954822
Triethylsilyloxymethyl-4-fluorobenzene
CID 11107483
2,2,2-Trifluoro-1-phenylethyl trimethylsilyl ether
CID 11218868
tert-Butyl(4-fluorobenzyloxy)dimethylsilane
CID 13861700
Silane, (1,1-dimethylethyl)dimethyl(phenylmethoxy)-
CID 596642
Dimethyl(diphenylmethoxy)(pentafluorophenyl)silane
CID 4581060
2-Fluorobenzyl alcohol, tert-butyldimethylsilyl ether
CID 91728155

Frequently Asked Questions

What is the IUPAC name of dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane?
The IUPAC name of dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane (CID 91724032) is dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane.
What is the SMILES notation for dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane?
The canonical SMILES for dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane is C[Si](C)(OCc1cc(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F.
What is the InChIKey of dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane?
The InChIKey is RGASSVKESWAWPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F9OSi/c1-26(2,15-13(23)11(21)10(20)12(22)14(15)24)25-4-5-3-6(16)8(18)9(19)7(5)17/h3H,4H2,1-2H3.
What are the key properties of dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane?
dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane has a molecular weight of 404.30 g/mol, XLogP of 4.57, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(2,3,4,5,6-pentafluorophenyl)-[(2,3,4,5-tetrafluorophenyl)methoxy]silane is sourced from PubChem (CID 91724032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).